2-methylsulfonylethyl 3-oxidanylidenebutanoate

Systemtic Name: 2-methylsulfonylethyl 3-oxidanylidenebutanoate Openeye Name: 2-methylsulfonylethyl 3-oxobutanoate CAS Name: 3-oxobutanoic acid 2-methylsulfonylethyl ester IUPAC Name: 2-methylsulfonylethyl 3-oxobutanoate Traditional Name: 3-ketobutyric acid 2-mesylethyl ester Formula: C7H12O5S MolecularWeight: 208.23218

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)OCCS(=O)(=O)C

Isomeric SMILES

CC(=O)CC(=O)OCCS(=O)(=O)C

InChI

InChI=1S/C7H12O5S/c1-6(8)5-7(9)12-3-4-13(2,10)11/h3-5H2,1-2H3